[4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]-pyridin-3-yl-methanone Openeye Name: [4-(4-phenylpiperazin-1-ium-1-yl)-1-piperidyl]-(3-pyridyl)methanone CAS Name: [4-(4-phenyl-1-piperazin-1-iumyl)-1-piperidinyl]-(3-pyridinyl)methanone IUPAC Name: [4-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]-pyridin-3-ylmethanone Traditional Name: [4-(4-phenylpiperazin-1-ium-1-yl)piperidino]-(3-pyridyl)methanone Formula: C21H27N4O+ MolecularWeight: 351.46528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

C1CN(CCC1[NH+]2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C21H26N4O/c26-21(18-5-4-10-22-17-18)25-11-8-20(9-12-25)24-15-13-23(14-16-24)19-6-2-1-3-7-19/h1-7,10,17,20H,8-9,11-16H2/p+1